Geometry & MOs

Info

ID:	291548
PubChem CID:	113436823
Reduced:	NO2C14H23 (1)
Stoich.:	AB2C14D23 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-84.37
Dipole, Da:	3.13
IP(EA), eV:	-8.41(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(4-methoxyphenyl)ethyl]hex-5-en-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C)N)OCCCCOC

DOS

IR

Vibrations